N-(2,5-dimethylphenyl)-N-ethyl-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-N-ethyl-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
N-(2,5-dimethylphenyl)-N-ethyl-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
Compound characteristics
| Compound ID: | C210-0154 |
| Compound Name: | N-(2,5-dimethylphenyl)-N-ethyl-2-{6-methyl-4-oxo-5-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thieno[2,3-d]pyrimidin-3(4H)-yl}acetamide |
| Molecular Weight: | 581.72 |
| Molecular Formula: | C27 H31 N7 O4 S2 |
| Smiles: | CCN(C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCN(CC1)c1ncccn1)(=O)=O)=O)c1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 3.127 |
| logD: | 3.127 |
| logSw: | -3.3545 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 94.365 |
| InChI Key: | PRDPNDUVGJKMIP-UHFFFAOYSA-N |